NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 556 T 4.2193 8.1631 115.2438 60.0522 69.0719 173.6509 557 G 3.9968 7.0870 105.5781 44.6364 0.0000 167.3112 558 E 4.9839 9.2204 119.1583 54.8663 32.6458 174.0729 559 M 4.8203 8.5554 120.4738 55.1861 33.5606 175.9444 560 G 4.1948 8.7626 106.9036 44.9755 0.0000 171.6732 561 I 4.6088 8.1531 122.7713 59.8060 38.9623 174.4682 562 L 5.1798 8.4092 129.4783 53.0520 44.6310 174.8511 563 W 5.5366 9.7210 126.2954 55.0483 32.2302 173.9521 564 E 5.3080 9.6505 126.0365 54.4800 31.8758 174.0642 565 F 4.5894 8.7292 128.5956 56.4454 41.1001 174.3167 566 D 4.3736 7.7001 126.2041 51.7606 42.1979 174.5380 567 P 3.9505 0.0000 0.0000 65.4781 31.5664 179.0657 568 I 3.6769 7.3305 116.1339 62.9001 37.9152 176.1989 569 I 4.1041 7.4651 110.9901 59.5958 38.3687 174.4251 570 N 4.0140 7.6637 118.8131 54.4234 37.7777 172.9932 571 K 5.0105 7.1024 114.1237 54.8116 37.7928 176.3561 572 W 5.3780 9.1852 121.5842 55.6798 31.6952 175.4076 573 I 4.7965 9.4011 124.7144 59.6785 39.0595 174.4074 574 R 4.4819 8.5441 127.3217 54.7005 31.6994 174.7852 575 L 5.0018 8.7360 126.3803 53.2093 46.4520 175.1310 576 S 5.2439 8.6046 112.6129 57.6602 66.8409 172.8046 577 M 5.1408 8.6691 117.1525 54.2721 35.1964 173.0437 578 K 5.1784 8.7905 120.3537 54.6003 35.3797 174.7024 579 L 5.2431 9.0621 125.9786 54.2280 44.8689 174.7761 580 K 4.8450 8.8572 121.1114 54.7005 34.9464 174.9664 581 V 4.6349 8.2697 127.3526 59.5041 33.0688 175.5316 582 E 4.0592 8.5370 124.9661 56.7590 29.7095 177.6746 583 R 4.0888 8.7710 121.6065 58.1938 30.6201 176.8429 584 K 4.8788 7.7846 115.4411 53.3730 34.9620 174.0363 585 P 3.8537 0.0000 0.0000 62.5785 31.7668 176.2490 586 F 4.5681 8.1858 114.4791 57.4627 39.0936 175.2418 587 A 4.3118 6.3269 122.9145 51.2607 21.8002 174.0535 588 E 4.8665 7.7584 115.8331 55.8201 30.7696 174.8635 589 G 3.9999 8.3136 106.9299 44.4397 0.0000 172.9189 590 A 4.2486 8.7275 120.8575 54.4655 18.9341 178.6438 591 L 4.6648 7.5879 113.6007 56.2418 43.9617 176.9762 592 R 5.1833 7.6984 115.1094 54.6629 35.4085 173.7309 593 E 5.0272 8.9233 118.7445 54.5043 33.0143 175.2154 594 A 5.1681 8.1267 124.3462 50.2425 22.1204 174.7647 595 Y 5.0475 9.0568 119.4101 56.0881 41.7972 175.2000 596 H 4.6077 9.0785 120.7950 56.7027 30.1817 174.4752 597 T 5.0154 8.3786 117.1158 62.1178 73.5620 173.0513 598 V 4.8824 8.3414 122.9143 59.8913 34.9228 174.6476 599 S 4.7875 9.4762 119.1023 58.0317 63.4822 174.0286 600 L 4.8702 8.7324 126.0247 54.4933 42.6685 175.8765 601 G 4.1366 7.3632 106.6099 43.7383 0.0000 173.5029 602 V 4.7011 8.1389 120.9467 61.1268 34.2928 175.0897 603 G 4.2143 8.9198 113.1605 45.6513 0.0000 171.5325 604 T 4.7172 8.5302 110.6697 60.5302 71.0171 174.3326 605 D 4.9431 8.2892 118.2303 53.1866 39.7803 178.0277 606 E 3.9746 8.2708 121.2467 60.1139 29.4464 178.1687 607 N 4.2297 8.0870 113.9085 54.9430 38.6343 174.6143 608 Y 4.5304 7.5354 116.2576 54.7380 37.8324 172.8807 609 P 4.2283 0.0000 0.0000 62.8572 32.0023 176.8663 610 L 4.0615 8.7973 124.5879 56.1740 42.4413 176.4936 611 G 3.9609 7.9100 104.2727 46.5098 0.0000 170.7437 612 T 4.1853 7.7270 116.0990 60.8497 68.7872 174.1540 *615 K 4.1159 8.2254 126.7383 55.9727 33.7453 175.2245 616 L 3.9752 8.3063 118.7357 55.3224 41.7424 177.1391 617 F 4.3700 8.3159 125.1044 55.6533 42.2294 172.1089 618 P 2.9700 0.0000 0.0000 61.2506 31.7764 174.3054 619 P 4.3499 0.0000 0.0000 62.1819 32.2085 176.9016 620 I 3.7569 8.5460 120.2919 64.4416 37.7569 177.1869 621 E 4.2149 8.1364 115.3292 57.9756 29.9905 176.8386 622 M 4.6071 8.6176 119.5658 55.0682 32.5246 174.8544 623 I 5.1067 7.3007 120.5789 59.2500 39.3824 175.4671 624 S 4.3371 9.0392 120.9750 57.6369 62.6673 172.5932 625 P 4.4916 0.0000 0.0000 64.1074 31.5945 176.3440 626 I 4.6828 7.2823 117.8263 59.6088 38.6849 175.3805 627 S 4.7226 8.3728 115.7782 57.8282 64.0884 175.9056 628 K 4.0402 8.2587 121.3108 59.0003 32.6338 176.0944 629 N 4.8838 7.1117 118.5204 51.7278 40.1359 173.2375 630 N 4.7109 8.1007 120.2955 52.2854 39.7178 174.4317 631 E 4.1967 9.3835 119.2784 59.0639 30.2520 179.3481 632 A 3.6833 8.3800 122.1112 55.3456 18.6189 179.3176 633 M 3.9942 8.4312 115.0601 58.3355 32.2447 177.6152 634 T 4.3164 7.7614 106.3906 63.3831 70.0914 175.9421 635 Q 4.2655 8.2121 119.6703 57.4643 28.9178 176.3224 636 L 4.6126 7.4935 117.9760 53.7947 42.9974 176.9811 637 K 4.0930 7.9108 117.1537 56.0364 33.3156 175.3927 638 N 4.3793 8.5666 118.0403 55.9423 38.7923 174.9023 639 G 4.0712 8.9707 113.9455 45.1879 0.0000 173.5293 640 T 4.2824 7.9182 117.4355 63.3127 69.8065 173.7930 641 K 5.0469 8.6546 125.0991 55.5783 33.9400 175.8385 642 F 5.0559 8.7730 118.6064 56.0493 42.1492 172.5443 643 V 4.9678 9.4511 118.3742 61.1934 34.2222 174.1311 644 L 5.3930 9.0758 129.7169 53.2961 44.6080 174.9040 645 K 5.3050 9.2468 125.3784 54.6788 35.3246 175.1565 646 L 5.0314 8.6737 123.2480 52.9675 45.6804 175.5412 647 Y 4.6717 8.6646 119.0894 57.6517 38.8838 175.6396 648 K 4.2820 9.5658 123.8531 57.0287 32.9600 177.5201 649 K 4.4496 7.7181 121.6997 55.1125 33.0970 174.5226 *654 Q 3.8752 8.2585 122.9464 56.6267 30.0850 173.4021 655 A 3.2702 8.1666 119.1501 54.2968 18.0716 175.7799 656 S 4.5220 7.7032 104.6825 56.3461 65.5394 176.7832 657 R 4.1034 8.7218 126.0558 60.0550 29.7388 178.4827 658 E 3.6517 7.9446 117.4918 59.2949 29.3311 178.9131 659 L 3.8698 7.5564 119.6880 58.4997 42.1067 178.8161 660 Y 4.1478 7.5460 115.1494 61.1813 37.7935 178.4645 661 F 4.1566 8.3348 118.2882 60.5063 39.0194 177.2036 662 E 4.0608 8.6178 119.0982 59.2082 29.4191 178.6579 663 D 4.4249 8.3304 119.1066 57.4663 41.0861 178.9292 664 V 3.6838 7.9380 118.6617 65.8272 31.5410 177.8967 665 K 3.6116 8.4369 119.5369 59.5948 31.9593 178.3831 666 M 4.2746 8.2097 118.5293 58.8625 32.2021 178.0449 667 Q 3.9340 8.1899 119.6871 59.2913 29.2325 178.0055 668 M 4.0849 8.0267 119.6147 58.3016 32.0278 178.7737 669 V 3.7218 7.9209 118.4405 66.3681 31.6174 177.9377 670 C 4.2097 8.0937 116.4405 62.6512 27.8426 176.1233 671 R 4.1026 7.9772 119.7534 59.5544 29.6990 178.7298 672 D 4.3879 8.0206 117.9949 57.2623 40.8076 178.9338 673 W 4.4104 8.3198 119.5021 59.7194 29.0500 178.6913 674 G 3.9156 8.9222 106.0760 48.1970 0.0000 175.5051 675 N 4.4787 8.3642 118.9598 55.7073 38.2924 177.4429 676 K 4.0127 8.0047 120.3470 59.4622 32.7479 178.1836 677 F 3.6152 8.6576 120.8792 61.4427 39.2418 176.8285 678 N 4.3113 8.4152 115.9404 56.4428 38.0969 177.3493 679 Q 4.0959 7.8043 117.9042 58.4075 28.8416 178.2441 680 K 4.0669 7.6751 117.3945 55.9329 33.3821 176.3806 681 K 3.6703 7.9131 118.4862 56.6350 29.2487 173.0162 682 P 4.5192 0.0000 0.0000 61.0905 32.9855 175.2251 683 P 4.3661 0.0000 0.0000 64.7353 31.3691 177.3770 684 K 4.5909 7.7470 116.1676 54.3511 35.2204 175.9973 685 K 4.5782 8.5816 123.1841 55.7211 33.1822 175.5530 686 I 4.5604 8.4569 114.5715 59.3701 40.9810 174.1471 687 E 4.6501 8.0166 121.2343 55.1262 33.1751 173.6234 688 F 5.0681 8.7196 124.7941 55.7170 40.8930 175.8319 689 L 4.2834 8.6535 122.5340 54.7845 42.2080 177.3328 690 M 3.9591 8.4565 120.8510 55.6334 32.5012 175.7941 691 S 4.8410 7.5587 114.7025 56.5179 66.1542 172.9473 692 W 5.5490 9.1859 123.1492 55.0886 33.7621 174.3581 693 V 4.5342 8.8620 122.9662 62.1056 32.9962 174.9450 694 V 5.0321 8.5411 126.4761 61.2089 34.9535 173.9529 695 E 4.4189 9.2295 128.2531 55.6354 30.6140 177.0539 696 L 4.5954 8.6625 128.6694 53.1766 40.1646 177.7106 697 I 3.8133 7.5286 113.9043 63.2586 38.1152 177.7387 698 D 4.5848 7.9929 118.9262 54.9993 41.1563 176.1049 699 R 4.6221 7.4546 118.5675 54.2449 31.9986 176.3680 700 S 4.3033 8.2968 116.9872 57.8098 63.5287 173.0579 701 P 5.1931 0.0000 0.0000 61.5548 32.3947 175.9534 *703 S 4.4841 8.4096 112.2822 58.6313 64.4510 174.1469 704 N 4.6157 8.2288 116.0223 52.5545 37.0740 175.6513 705 G 3.8785 8.2128 105.1285 46.1961 0.0000 173.7942 706 Q 4.1638 8.1302 120.2710 54.6955 29.0559 174.3011 707 P 4.6373 0.0000 0.0000 62.2323 32.3379 175.8476 708 I 4.1134 8.1638 122.2070 61.0666 38.1293 175.0741 709 L 5.1330 8.1307 126.1102 53.2732 45.4561 174.7276 710 C 4.7528 8.0609 114.4685 57.7727 33.5301 172.4903 711 S 5.5535 8.7302 113.2507 56.5712 66.0844 173.1059 712 I 5.5667 8.8002 114.2556 59.7978 41.4585 173.5880 713 E 5.4220 9.1561 119.1589 55.0559 33.0624 173.0607 714 P 4.9527 0.0000 0.0000 62.4610 32.5053 175.8601 715 L 4.3700 8.5281 123.6442 54.4213 42.6996 176.0695 716 L 4.4068 8.6304 126.4715 53.8547 42.5364 176.0667 717 V 4.0945 8.5186 123.8567 61.6152 32.6588 173.9157 718 G 3.6740 8.6026 112.6785 43.8764 0.0000 172.4229 719 E 4.3128 8.5839 120.6573 55.6945 29.5135 176.5795 720 F 4.5573 8.8270 128.0802 57.8385 40.4500 174.7784 721 K 4.7978 8.6075 124.5665 54.5983 36.6030 174.9337 722 K 4.6661 8.7976 125.2949 55.4655 32.9329 175.4297 723 N 4.8836 9.1935 125.2884 54.6734 40.6042 174.6641 724 N 5.5587 7.8654 114.0265 51.6086 41.4032 174.4846 725 S 5.1778 8.5497 114.5859 56.2013 65.3886 173.7026 726 N 4.8768 8.6335 116.6302 53.4603 37.1306 175.0061 727 Y 4.7274 8.1049 120.0075 57.3252 39.0091 175.5462 728 G 3.9076 8.7614 106.3967 44.6709 0.0000 174.4071 729 A 4.1492 7.9498 123.4364 51.5404 19.2835 176.4240 730 V 4.4853 8.2572 121.7904 61.2439 32.9698 175.1010 731 L 4.5433 8.6810 127.3137 54.9203 43.0402 175.9387 732 T 4.7444 7.4998 106.4960 59.8443 71.8080 173.0809 733 N 4.6352 8.5237 116.8997 53.9518 39.1768 176.3751 734 R 4.1215 7.8380 117.0229 56.7338 31.0650 177.1210 735 S 4.5001 8.6392 116.2310 61.3292 63.4857 176.9644 736 T 4.0274 7.9235 117.9121 66.5111 67.9156 174.6512 737 P 4.2673 0.0000 0.0000 65.6305 31.4583 178.6270 738 Q 4.2435 8.1765 116.1991 58.6006 28.7771 178.1277 739 A 4.2773 8.3333 122.1115 54.8958 18.3976 179.4926 740 F 3.9486 8.3835 119.3091 61.4698 39.3133 177.2091 741 S 3.7307 7.7325 114.3575 61.9137 62.6625 176.1526 742 H 4.1516 8.1128 120.0847 59.3773 29.5428 176.5281 743 F 4.0849 8.5492 122.9682 61.9545 38.6679 177.4580 744 T 2.7196 7.4657 108.8775 64.2561 68.3055 175.9762 745 Y 4.4693 7.2999 123.8771 59.9220 38.9672 177.4284 746 E 3.7119 8.0994 120.1385 59.3046 29.6885 178.5745 747 L 4.0666 7.5587 116.7258 56.5614 41.9927 177.8097 748 S 4.6510 7.7238 112.5011 57.4850 63.3142 173.9409 749 N 4.2790 8.2904 116.6805 54.8062 36.2074 174.2669 750 K 3.0398 7.4551 112.0304 57.4484 30.1750 176.8988 751 Q 4.2895 7.5844 116.5037 56.9207 29.5179 175.4740 752 M 4.6939 7.2477 115.5789 54.9122 35.6987 172.9499 753 I 4.4474 7.9762 122.8656 59.3575 42.2044 173.5618 754 V 4.3409 7.7677 128.9151 61.7657 32.6158 175.0744 755 V 4.3390 7.8758 122.0084 60.4253 35.7457 174.1642 756 D 4.9757 8.4826 114.4371 55.1924 39.3191 174.8365 757 I 3.9366 8.5495 120.8687 60.7678 37.5873 175.8181 758 Q 4.7588 7.8863 122.6203 53.7405 31.9273 175.3093 759 G 3.4150 6.7106 105.6029 45.8566 0.0000 170.4084 760 V 4.6012 7.2318 120.4984 62.2402 33.8338 176.6029 761 D 4.2038 8.1768 127.4869 56.1348 40.3207 174.3522 762 D 4.0971 8.3188 124.3628 54.6207 41.8753 174.1462 763 L 4.2140 7.7121 122.4036 53.8207 43.5235 174.6642 764 Y 5.2445 8.1762 124.5768 56.8504 41.1399 174.7145 765 T 5.0855 8.7992 114.9231 60.3772 71.3497 172.6779 766 A 3.8414 8.2431 124.3377 52.5330 16.4461 174.6141 767 P 4.9078 0.0000 0.0000 63.0144 33.3862 176.5144 768 Q 4.5930 8.7802 120.1515 54.3199 32.5881 173.5734 769 I 4.6579 8.1369 125.3658 59.7846 40.2810 173.9834 770 H 5.4641 8.3696 123.3488 54.3765 31.3518 173.9123 771 T 4.9511 8.4909 110.9522 59.2142 72.0538 173.0612 772 P 4.2609 0.0000 0.0000 65.8364 31.3620 177.5400 773 D 4.4730 8.1776 113.9760 53.1516 39.8529 176.8024 774 G 3.9541 7.5064 107.4046 46.2593 0.0000 173.6796 775 K 4.3392 8.4866 118.5574 55.6256 33.6020 177.5222 776 G 3.7229 8.6224 109.7880 45.6954 0.0000 172.6732 777 F 3.9257 8.8735 114.0679 58.4720 37.3143 178.1197 778 G 3.7583 8.1074 108.6866 46.9225 0.0000 175.6892 779 L 4.2154 8.5298 118.2764 56.8953 42.4097 178.2445 780 G 3.7233 7.9614 104.1674 45.6008 0.0000 173.0147 781 N 4.7416 7.5630 117.9605 52.9989 38.1144 174.0409 782 L 4.6228 8.9087 125.7928 53.7366 42.9398 178.0892 783 G 4.3390 8.5023 108.4598 46.3180 0.0000 176.2928 784 K 3.8991 8.7132 116.8920 59.5056 32.1386 178.7375 785 A 4.1028 8.0374 120.8037 55.1225 18.4973 179.7874 786 G 3.2703 7.9049 103.8995 47.6489 0.0000 175.9992 787 I 3.5423 7.3213 122.1186 64.2804 37.1429 178.1085 788 N 4.2211 8.0241 117.1195 56.3666 38.1428 177.5507 789 K 3.7213 7.4383 118.2334 59.2941 32.1466 178.7852 790 F 4.0908 7.9829 120.6229 61.1743 39.1275 177.1516 791 I 3.4964 7.6082 119.2996 64.7017 36.7016 178.2755 792 T 3.8030 7.4205 115.3078 66.5206 68.4447 175.7712 793 T 4.2462 6.7907 107.2628 60.7633 69.6315 174.1212 794 H 4.0239 6.9970 123.0759 55.5177 30.3812 174.0802 795 K 4.3505 7.9494 127.3971 54.1754 34.1320 175.3876 796 C 4.4484 8.5175 121.4060 58.0730 30.8312 172.7045 797 N 5.1818 8.2450 117.6286 51.0376 39.7170 174.3448 798 A 4.1029 8.5406 117.7609 55.3436 18.3808 180.1699 799 V 3.6133 7.9623 116.8599 66.1801 31.7745 177.5138 800 C 4.1186 8.5027 116.3969 63.0172 27.9488 176.2282 801 A 3.9605 8.0724 121.8462 55.3625 17.8617 179.4167 802 L 3.9167 7.9691 116.3641 58.0663 41.8270 179.1768 803 L 4.2690 7.9445 115.7842 54.2462 42.0208 176.1407 804 D 4.4639 8.1920 117.7706 55.2294 39.9388 173.7006 805 L 4.3763 7.6823 116.1769 53.3234 41.4972 176.4549 806 D 4.5564 8.8960 121.2875 54.0298 41.5914 178.0795 807 V 3.8916 8.4508 119.8735 63.9394 32.0093 176.2981 808 K 4.1974 7.7392 123.4587 56.6255 31.7897 176.6253 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 556 T 8.16 4.22 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 557 G 7.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 558 E 9.22 4.98 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.25 0.00 559 M 8.56 4.82 0.00 1.89 2.02 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.67 0.00 560 G 8.76 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 561 I 8.15 4.61 1.94 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.78 0.74 0.00 0.00 562 L 8.41 5.18 0.00 1.68 1.40 0.87 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 563 W 9.72 5.54 0.00 3.43 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 564 E 9.65 5.31 0.00 2.57 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 565 F 8.73 4.59 0.00 1.51 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 566 D 7.70 4.37 0.00 2.52 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 567 P 0.00 3.95 0.00 2.20 2.15 0.00 3.47 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 568 I 7.33 3.68 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.69 0.87 0.00 0.00 569 I 7.47 4.10 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.77 0.85 0.00 0.00 570 N 7.66 4.01 0.00 2.81 2.87 0.00 0.00 6.88 6.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 571 K 7.10 5.01 0.00 1.63 1.68 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.56 7.81 572 W 9.19 5.38 0.00 3.67 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 I 9.40 4.80 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.07 0.96 0.00 0.00 574 R 8.54 4.48 0.00 1.16 1.57 0.00 2.46 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.50 0.00 575 L 8.74 5.00 0.00 1.44 1.66 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 576 S 8.60 5.24 0.00 3.80 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 577 M 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8.29 4.28 0.00 2.88 2.87 0.00 0.00 6.92 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 750 K 7.46 3.04 0.00 1.66 1.41 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 0.92 7.81 751 Q 7.58 4.29 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.63 2.44 0.00 752 M 7.25 4.69 0.00 1.85 1.83 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.22 0.00 753 I 7.98 4.45 1.71 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.83 0.70 0.00 0.00 754 V 7.77 4.34 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.48 0.00 0.00 755 V 7.88 4.34 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.92 0.00 0.00 756 D 8.48 4.98 0.00 2.90 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 757 I 8.55 3.94 1.61 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.95 -0.29 0.00 0.00 758 Q 7.89 4.76 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.98 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 759 G 6.71 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 760 V 7.23 4.60 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.00 0.00 0.00 761 D 8.18 4.20 0.00 2.71 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 762 D 8.32 4.10 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 763 L 7.71 4.21 0.00 1.54 1.48 0.81 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 764 Y 8.18 5.24 0.00 1.64 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 765 T 8.80 5.09 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 766 A 8.24 3.84 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 767 P 0.00 4.91 0.00 2.03 2.27 0.00 3.99 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.82 0.00 768 Q 8.78 4.59 0.00 2.15 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 769 I 8.14 4.66 1.14 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.76 0.23 0.00 0.00 770 H 8.37 5.46 0.00 2.99 3.27 0.00 5.55 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 771 T 8.49 4.95 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 772 P 0.00 4.26 0.00 2.09 2.20 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 773 D 8.18 4.47 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 774 G 7.51 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 775 K 8.49 4.34 0.00 1.88 1.74 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.55 7.81 776 G 8.62 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 777 F 8.87 3.93 0.00 3.27 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 778 G 8.11 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 779 L 8.53 4.22 0.00 1.71 1.69 0.66 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 780 G 7.96 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 781 N 7.56 4.74 0.00 3.00 2.86 0.00 0.00 7.07 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 782 L 8.91 4.62 0.00 1.72 1.70 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 783 G 8.50 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 784 K 8.71 3.90 0.00 1.82 1.89 0.00 1.69 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.76 7.81 785 A 8.04 4.10 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 786 G 7.90 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 787 I 7.32 3.54 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.80 0.63 0.00 0.00 788 N 8.02 4.22 0.00 2.81 2.79 0.00 0.00 7.10 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 K 7.44 3.72 0.00 1.47 1.58 0.00 1.25 0.00 0.00 1.32 0.00 0.00 2.54 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.02 0.21 7.81 790 F 7.98 4.09 0.00 3.07 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 791 I 7.61 3.50 1.94 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.90 0.86 0.00 0.00 792 T 7.42 3.80 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 793 T 6.79 4.25 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 794 H 7.00 4.02 0.00 2.06 2.86 0.00 5.89 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 795 K 7.95 4.35 0.00 1.57 1.52 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 1.37 7.81 796 C 8.52 4.45 0.00 3.24 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 797 N 8.24 5.18 0.00 2.95 2.99 0.00 0.00 5.93 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 798 A 8.54 4.10 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 799 V 7.96 3.61 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.01 0.00 0.00 800 C 8.50 4.12 0.00 3.35 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 801 A 8.07 3.96 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 802 L 7.97 3.92 0.00 1.77 1.77 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 803 L 7.94 4.27 0.00 1.94 1.86 1.02 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 804 D 8.19 4.46 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 805 L 7.68 4.38 0.00 1.69 1.44 0.97 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 806 D 8.90 4.56 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 807 V 8.45 3.89 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.96 0.00 0.00 808 K 7.74 4.20 0.00 2.22 1.75 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.54 7.81 * Residues marked with a * may have inaccurate shift predictions.